CID 9267

Cyclodecane

Structural Information

Molecular Formula

C₁₀H₂₀

SMILES

C1CCCCCCCCC1

InChI

InChI=1S/C10H20/c1-2-4-6-8-10-9-7-5-3-1/h1-10H2

InChIKey

LMGZGXSXHCMSAA-UHFFFAOYSA-N

Compound name

cyclodecane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 12
References: 54265
Patents: 140.1565 Da
Monoisotopic Mass: 5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	141.163776	131.8
[M+Na]+	163.145718	133.9
[M-H]-	139.149224	131.1
[M+NH4]+	158.190323	150.1
[M+K]+	179.119658	134.1
[M+H-H2O]+	123.153760	129.1
[M+HCOO]-	185.154701	149.9
[M+CH3COO]-	199.170351	169.1
[M+Na-2H]-	161.131166	136.0
[M]+	140.15595142	121.5
[M]-	140.15704858	121.5

Literature stripe

literature stripe

Patent stripe

patents stripe